smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC([NH3+])C[N+](=O)[O-]	140902902	169168511	/nfs/dbraw/zinc/16/85/11/169168511.db2.gz	JDXRSPWAJJOTGZ-UHFFFAOYSA-N	1	2	105.097	-1.493	40	5		AABBLO
NNc1ncc([N+](=O)[O-])c(NN)[nH+]1	5758200	169238255	/nfs/dbraw/zinc/23/82/55/169238255.db2.gz	SSZAFSKNVPOERJ-UHFFFAOYSA-N	1	2	185.147	-1.044	40	5		AABBLO
[NH3+][C@@H]1NC(=O)C=C[C@@H]1[N+](=O)[O-]	3852556	169260268	/nfs/dbraw/zinc/26/02/68/169260268.db2.gz	WSIAMMRBYIRACX-WVZVXSGGSA-N	1	2	157.129	-1.398	40	5		AABBLO
[NH3+][C@@H]1NC(=O)C=C[C@H]1[N+](=O)[O-]	3852554	169260282	/nfs/dbraw/zinc/26/02/82/169260282.db2.gz	WSIAMMRBYIRACX-NQXXGFSBSA-N	1	2	157.129	-1.398	40	5		AABBLO
[NH3+][C@H]1NC(=O)C=C[C@H]1[N+](=O)[O-]	3852552	169279454	/nfs/dbraw/zinc/27/94/54/169279454.db2.gz	WSIAMMRBYIRACX-WUJLRWPWSA-N	1	2	157.129	-1.398	40	5		AABBLO
[NH3+][C@H]1NC(=O)C=C[C@@H]1[N+](=O)[O-]	3852555	169280072	/nfs/dbraw/zinc/28/00/72/169280072.db2.gz	WSIAMMRBYIRACX-UCORVYFPSA-N	1	2	157.129	-1.398	40	5		AABBLO